SCHEMBL2662250

SCHEMBL2662250

COc1ccc(CN(Cc2ccc(C(C)C)cc2)Cc2ccc(C(=O)NCCC(=O)O)s2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.45
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
OPRK1 P41145 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2662005 0.86 GAA (0.54) LMNAALDH1A1KMT2AGAAL3MBTL1
SCHEMBL9072777 0.79 GCGR (0.41) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL4087544 0.79 KDM4E (0.44) NAMPTLMNAKMT2AGAAKDM4E
SCHEMBL2663028 0.78 NPC1 (0.49) LMNAKMT2AL3MBTL1MAPTSMN1; SMN2
SCHEMBL2662252 0.78 ALDH1A1 (0.48) NAMPTLMNAALDH1A1KMT2AGAA
SCHEMBL2662006 0.70 ALDH1A1 (0.52) LMNAALDH1A1KMT2AGAAMAPT
SCHEMBL6790843 0.68 NAMPT (0.78) NAMPTLMNAALDH1A1KMT2AGAA
SCHEMBL4091423 0.68 ACKR3 (0.52) L3MBTL1SMN1; SMN2ACHE
SCHEMBL2661984 0.68 AKT3 (0.42)
SCHEMBL6295894 0.68 AKT3 (0.39) KMT2AL3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
CN-1356977-A Glucagon antagonists/inverse agonists NOVO NORDISK AS (DK) 2002-07-03 CN disclosed
EP-1183229-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR NAMPT 1813/4885LMNA 3643/4885ALDH1A1 3968/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR NAMPT 1813/4885LMNA 3643/4885ALDH1A1 3968/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.